Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
터트-부틸 퍼옥시아세테이트
3차부틸퍼옥시아세테이트 · T-부틸퍼옥시디에틸아세테이트 · t-부틸퍼옥시아세테이트 · 과초산t-부틸 · 터셔리부틸퍼옥시아세테이트(57%이상) · 터트-부틸퍼옥시아세테이트 · 터트-부틸 퍼옥시아세테이트 · tert-butyl
식별자 및 물리적 특성
| CAS No. | 107-71-1 |
|---|---|
| 분자식 | C6H12O3 |
| 평균 분자량 | 132.16 g/mol |
| 단동위원소 질량 | 132.07864424 g/mol |
| SMILES | CC(=O)OOC(C)(C)C |
| InChIKey | SWAXTRYEYUTSAP-UHFFFAOYSA-N |
| PubChem CID | 61019 |
| EC No. | 203-514-5 |
| DTXSID | DTXSID9029142 |
| 현지명 | 터트-부틸 퍼옥시아세테이트 |
화학 및 물리적 성질
| XLogP | 1.1 |
|---|---|
| 극성 표면적 | 35.5 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 3 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 9 |
| 형식 전하 | 0 |
| 복잡도 | 101 |
| 물질 분류 | Other Classes -> Peroxides, OrganicFlammable agents - 3rd degree |
| SpringerMaterials Properties | Chemical shift |
| Food Contact Substances | FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR |
| Physical Description | This liquid peroxide is sensitive to heat. Storage of this material must be done so with stringent temperature control measures. Its explosion hazard is also mitigated by mixing the peroxide with an inert solid.[CAMEO] Solution in 10-30% aliphatic hydrocarbons (Stoddard type): Light yellow liquid with a pungent odor[Sigma-Aldrich MSDS] |
| 녹는점 | -20 °C |
| 끓는 점 | 184.08°C (rough estimate) |
| 밀도 | 0.828 g/mL at 25 °C |
| 증기압 | 1.966Pa at 25℃ |
| 굴절률 | n20/D 1.412 |
| 인화점 | 99 °F |
| 저장 조건 | Refrigerator (+4°C) + Flammables area |
| 물리적 상태 | 액체 |
| 색상 | 투명한 |
| 용해도 | 3.878g/L at 25℃ |
| InChI | InChI=1S/C6H12O3/c1-5(7)8-9-6(2,3)4/h1-4H3 |
| InChIKey | SWAXTRYEYUTSAP-UHFFFAOYSA-N |
| SMILES | C(OOC(C)(C)C)(=O)C |
| LogP(분배 계수) | 1.6 at 25℃ |
| EPA | tert-Butyl peroxyacetate (107-71-1) |
화학적 성질
clear solution
안전 및 규제
| GHS 분류 | DangerH226 (19.4%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P234, P235, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P321, P330, P333+P317, P337+P317, P362+P364, P370+P378, P391, P403, P403+P233, P403+P235, P405, P410, P411, P420, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 629 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H201: (Deleted) Explosivemass explosion hazard [Danger Explosives] |
|---|---|
| 규제 정보 | Chemical: Ethaneperoxoic acid, 1,1-dimethylethyl esterEthaneperoxoic acid, 1,1-dimethylethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethaneperoxoic acid, 1,1-dimethylethyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 31-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/22656Ethaneperoxoic acid, 1,1-dimethylethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| 운송 라벨(DOT) | Organic Peroxide Explosive |
| 화재 위험 | Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]: |
| 건강 유해성 | Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]: |
| 유해성 요약 | A strong oxidizer that may cause fire or explosion on contact with combustible materialsExplosive and sensitive to heat and shock[CAMEO] A moderate eye irritantCauses respiratory depression, GI bleeding, abnormal liver function results, and effects on spermatogenesis in acute inhalation studies (species not specified)Causes abnormal recording from peripheral motor nerves, proteinuria, hemolysis, and effects on spermatogenesis and male reproductive organs in acute inhalation studies of rats |
용도
용도
Polymerization initiator for vinyl monomers, manufacture of polyethylene and polystyrene.
일반 설명
tert-Butyl peroxyacetate is sensitive to heat. Storage of tert-Butyl peroxyacetate must be done so with stringent temperature control measures. It's explosion hazard is also mitigated by mixing the peroxide with an inert solid.